[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-(5-chloranyl-2-methoxy-phenyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-(5-chloranyl-2-methoxy-phenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 1-(5-chloro-2-methoxy-phenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(5-chloro-2-methoxyphenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 1-(5-chloro-2-methoxyphenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C20H25ClN2O4 MolecularWeight: 392.8765

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=C(N(C(=C1)C)C2=C(C=CC(=C2)Cl)OC)C

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=C(N(C(=C1)C)C2=C(C=CC(=C2)Cl)OC)C

InChI

InChI=1S/C20H25ClN2O4/c1-6-12(2)22-19(24)11-27-20(25)16-9-13(3)23(14(16)4)17-10-15(21)7-8-18(17)26-5/h7-10,12H,6,11H2,1-5H3,(H,22,24)